Geometry & MOs

Info

ID:

180746

PubChem CID:

76679658

Reduced:

N2O4H13C14 (2)

Stoich.:

A2B4C13D14 (2)

Weight, g/mol:

526.141239

ΔHf, kcal/mol:

-249.47

Dipole, Da:

8.13

IP(EA), eV:

 -9.19(-1.01)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-[(4-fluoro-5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-[6-fluoro-5-(3-methyl-2-oxoimidazolidin-1-yl)furo[3,2-b]pyridin-2-yl]imidazolidine-2,4-dione

Drug info:

PubChemData

Smile

CCOC(=O)C1CCC(=O)N1C2=NC3=C(C=C2)OC(=C3)C4(CC(=O)NC4=O)CN5CC6=C(C5=O)C=C(C=C6)OC

DOS

IR

Vibrations